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Substance Name: Pedicularioside H
RN: 138989-16-9
InChIKey: CPJOAPUBOVBXHM-RMKNXTFCSA-N

Molecular Formula

  • C36-H48-O19

Molecular Weight

  • 784.7562
 
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Names and Synonyms

Name of Substance

  • Pedicularioside H

Synonym

  • 1'-O-beta-D-(3-Methoxy-4-hydroxy-beta-phenyl)ethyl-4'-O-feruloyl-beta-D-apiosyl(1-3')-alpha-L-rhamnosyl-(1-6')-glucopyranoside

Systematic Name

  • beta-D-Glucopyranoside, 2-(4-hydroxy-3-methoxyphenyl)ethyl O-D-apio-beta-D-furanosyl-(1-3)-O-(6-deoxy-alpha-L-mannopyranosyl-(1-6))-, 4-(3-(4-hydroxy-3-methoxyphenyl)-2-propenoate), (E)-

Registry Numbers

CAS Registry Number

  • 138989-16-9

System Generated Number

  • 0138989169

Structure Descriptors

InChI

1S/C36H48O19/c1-17-26(41)27(42)28(43)33(52-17)50-14-24-30(54-25(40)9-6-18-4-7-20(38)22(12-18)47-2)31(55-35-32(45)36(46,15-37)16-51-35)29(44)34(53-24)49-11-10-19-5-8-21(39)23(13-19)48-3/h4-9,12-13,17,24,26-35,37-39,41-46H,10-11,14-16H2,1-3H3/b9-6+

InChIKey

CPJOAPUBOVBXHM-RMKNXTFCSA-N

Smiles

CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OCCc3ccc(c(c3)OC)O)O)OC4C(C(CO4)(CO)O)O)OC(=O)/C=C/c5ccc(c(c5)OC)O)O)O)O